Geometry & MOs

Info

ID:	363236
PubChem CID:	127310377
Reduced:	O3N4C22H30 (1)
Stoich.:	A3B4C22D30 (1)
Weight, g/mol:	356.221226
ΔH_f, kcal/mol:	-77.37
Dipole, Da:	5.22
IP(EA), eV:	-9.11(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,4-dimethylphenyl)ethyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)NCC3CCCOC3C4=CC=CC=C4

DOS

IR

Vibrations